2-(aminocarbonylamino)-4-methylsulfanyl-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]butanamide

Systemtic Name: 2-(aminocarbonylamino)-4-methylsulfanyl-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]butanamide Openeye Name: 4-methylsulfanyl-N-[(6-morpholino-3-pyridyl)methyl]-2-ureido-butanamide CAS Name: 2-(carbamoylamino)-4-(methylthio)-N-[[6-(4-morpholinyl)-3-pyridinyl]methyl]butanamide IUPAC Name: 2-(carbamoylamino)-4-methylsulfanyl-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]butanamide Traditional Name: 4-(methylthio)-N-[(6-morpholino-3-pyridyl)methyl]-2-ureido-butyramide Formula: C16H25N5O3S MolecularWeight: 367.4664

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CN=C(C=C1)N2CCOCC2)NC(=O)N

Isomeric SMILES

CSCCC(C(=O)NCC1=CN=C(C=C1)N2CCOCC2)NC(=O)N

InChI

InChI=1S/C16H25N5O3S/c1-25-9-4-13(20-16(17)23)15(22)19-11-12-2-3-14(18-10-12)21-5-7-24-8-6-21/h2-3,10,13H,4-9,11H2,1H3,(H,19,22)(H3,17,20,23)